7-(2-chloroethyl)-1-(phenylmethyl)-1,4-diazepine dihydrochloride

Systemtic Name: 7-(2-chloroethyl)-1-(phenylmethyl)-1,4-diazepine dihydrochloride Openeye Name: 1-benzyl-7-(2-chloroethyl)-1,4-diazepine dihydrochloride CAS Name: 7-(2-chloroethyl)-1-(phenylmethyl)-1,4-diazepine dihydrochloride IUPAC Name: 1-benzyl-7-(2-chloroethyl)-1,4-diazepine dihydrochloride Traditional Name: 1-benzyl-7-(2-chloroethyl)-1,4-diazepine dihydrochloride Formula: C14H17Cl3N2 MolecularWeight: 319.65718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CN=CC=C2CCCl.Cl.Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CN=CC=C2CCCl.Cl.Cl

InChI

InChI=1S/C14H15ClN2.2ClH/c15-8-6-14-7-9-16-10-11-17(14)12-13-4-2-1-3-5-13;;/h1-5,7,9-11H,6,8,12H2;2*1H